4-(4-chlorophenyl)-1,3-dimethyl-4,8-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one
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![4-(4-chlorophenyl)-1,3-dimethyl-4,8-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/649586aec2564f2589e97b86f95820d4.png "4-(4-chlorophenyl)-1,3-dimethyl-4,8-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one")
4-(4-chlorophenyl)-1,3-dimethyl-4,8-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one
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CAS No:
54369-21-0
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Formula:
C14H14ClN3OS
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Chemical Name:
4-(4-chlorophenyl)-1,3-dimethyl-4,8-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one
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Synonyms:
Abbott 34519;Abbott 34519;54369-21-0;Oprea1_066579;DTXSID40969465;STL156116;AKOS005755672;AKOS032410432;MCULE-8767492164;4-(p-Chlorophenyl)-1,3-dimethyl-1H-pyrazole(3,4-e)(1,4)thiazepin-7-one;4-(4-Chlorophenyl)-1,3-dimethyl-2,4-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one;4-(4-chlorophenyl)-1,3-dimethyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol;4-(4-chlorophenyl)-1,3-dimethyl-4,8-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one;4-(4-chlorophenyl)-1,3-dimethyl-6,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(4H)-one
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CAS No:
4-(4-chlorophenyl)-1,3-dimethyl-4,8-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one Basic Attributes
307.8 g/mol
307.0546109 g/mol
Computed Properties
Molecular Weight:307.8
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:307.0546109
Monoisotopic Mass:307.0546109
Topological Polar Surface Area:72.2
Heavy Atom Count:20
Complexity:375
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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